Vitas-M small molecule compound

N-[3-(4-methoxyphenoxy)-5-nitrophenyl]-1-methyl-4-nitro-1H-pyrazole-3-carboxamide

Catalog ID
STK302375
SMILES COc1ccc(cc1)Oc1cc(NC(=O)c2nn(cc2[N+](=O)[O-])C)cc(c1)[N+](=O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C18H15N5O7 MW 413.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N5O7/c1-21-10-16(23(27)28)17(20-21)18(24)19-11-7-12(22(25)26)9-15(8-11)30-14-5-3-13(29-2)4-6-14/h3-10H,1-2H3,(H,19,24)
InChIKey
FRZIAIPAFVZFID-UHFFFAOYSA-N
Synonyms
512823-72-2
4NITRON(3NITRO5(4METHOXYPHENOXY)PHENYL)1METHYL1HPYRAZOLE3CARBOXAMIDE
512823722
CN1C=C(C(=N1)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)OC)(N+)(=O)(O))(N+)(=O)(O)
COc1ccc(cc1)Oc1cc(NC(=O)c2nn(cc2(N+)(=O)(O))C)cc(c1)(N+)(=O)(O)
InChI=1SC18H15N5O7c1211016(23(27)28)17(2021)18(24)1911712(22(25)26)915(811)30145313(292)4614h310H12H3(H1924)
MFCD03468425
N(3(4methoxyphenoxy)5nitrophenyl)1methyl4nitro1Hpyrazole3carboxamide
N(3(4METHOXYPHENOXY)5NITROPHENYL)1METHYL4NITRO3PYRAZOLECARBOXAMIDE
N(3(4METHOXYPHENOXY)5NITROPHENYL)1METHYL4NITROPYRAZOLE3CARBOXAMIDE
ZINC000002735426
ZINC02735426
ZINC2735426

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.